ChemSpider 2D Image | dehypoxanthine futalosine | C14H16O7

dehypoxanthine futalosine

  • Molecular FormulaC14H16O7
  • Average mass296.273 Da
  • Monoisotopic mass296.089600 Da
  • ChemSpider ID21865861

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-{3-[(2R,3S,4R)-3,4,5-Trihydroxytetrahydro-2-furanyl]propanoyl}benzoesäure [German] [ACD/IUPAC Name]
3-{3-[(2R,3S,4R)-3,4,5-Trihydroxytetrahydro-2-furanyl]propanoyl}benzoic acid [ACD/IUPAC Name]
Acide 3-{3-[(2R,3S,4R)-3,4,5-trihydroxytétrahydro-2-furanyl]propanoyl}benzoïque [French] [ACD/IUPAC Name]
dehypoxanthine futalosine
D-ribo-Heptodialdo-1,4-furanose, 7-(3-carboxyphenyl)-5,6-dideoxy- [ACD/Index Name]
3-{3-[(2R,3S,4R)-3,4,5-trihydroxytetrahydrofuran-2-yl]propanoyl}benzoic acid
7-(3-carboxyphenyl)-5,6-dideoxy-D-ribo-heptodialdo-1,4-furanose
de(hypoxanthine)futalosine
de-hypoxanthine futalosine

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CHEBI:51312 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 583.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 222.6±23.6 °C
Index of Refraction: 1.638
Molar Refractivity: 70.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.45
ACD/LogD (pH 5.5): -1.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 124 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 71.3±3.0 dyne/cm
Molar Volume: 196.7±3.0 cm3

Click to predict properties on the Chemicalize site


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